Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | NMUR2 | Q9GZQ4 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3926773 | 1.00 | ALDH1A1 (0.43) | ALDH1A1MAPTLMNASMN1; SMN2CHRNA7 | |
| SCHEMBL315436 | 1.00 | ALDH1A1 (0.43) | ALDH1A1MAPTLMNASMN1; SMN2CHRNA7 | |
| SCHEMBL3920170 | 0.82 | ALDH1A1 (0.41) | ALDH1A1MAPTLMNASMN1; SMN2CHRNA7 | |
| SCHEMBL3920174 | 0.82 | ALDH1A1 (0.41) | ALDH1A1MAPTLMNASMN1; SMN2CHRNA7 | |
| SCHEMBL7859393 | 0.82 | ALDH1A1 (0.41) | ALDH1A1MAPTLMNASMN1; SMN2CHRNA7 | |
| SCHEMBL6579051 | 0.80 | ALDH1A1 (0.40) | ALDH1A1MAPTLMNASMN1; SMN2CHRNA7 | |
| SCHEMBL6576494 | 0.80 | ALDH1A1 (0.40) | ALDH1A1MAPTLMNASMN1; SMN2CHRNA7 | |
| SCHEMBL6576487 | 0.80 | ALDH1A1 (0.40) | ALDH1A1MAPTLMNASMN1; SMN2CHRNA7 | |
| SCHEMBL10799093 | 0.80 | TAAR1 (0.39) | ALDH1A1LMNASMN1; SMN2AOC3TDP1 | |
| SCHEMBL6493189 | 0.78 | TSHR (0.46) | ALDH1A1MAPTLMNASMN1; SMN2CHRNA7 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114560892-A | Chiral tridentate nitrogen phosphine ligand synthesized based on ferrocene skeleton and application thereof | 广东工业大学 | 2022-05-31 | — | — | CN | disclosed |